Mol:FL2FAANP0004
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 30 34 0 0 0 0 0 0 0 0999 V2000 -1.8935 -1.0317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3727 -1.3324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8518 -1.0317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8518 -0.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3727 -0.1295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8935 -0.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3309 -1.3324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -1.0317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -0.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3309 -0.1295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7104 -0.1298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3309 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2447 -0.4383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7791 -0.1298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7791 0.4872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2447 0.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7104 0.4872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4144 -0.1295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3727 0.4714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 0.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3134 0.7958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7791 1.7213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2447 1.4128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4144 0.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5739 1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9749 0.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3134 1.4128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6139 1.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9749 1.2356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3727 -1.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 3 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 4 1 0 0 0 0 9 11 1 0 0 0 0 7 12 2 0 0 0 0 11 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 11 1 0 0 0 0 6 18 1 0 0 0 0 5 19 1 0 0 0 0 19 20 2 0 0 0 0 15 21 1 0 0 0 0 22 23 2 0 0 0 0 23 16 1 0 0 0 0 20 24 1 0 0 0 0 24 18 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 21 27 1 0 0 0 0 27 22 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 2 30 1 0 0 0 0 S SKP 8 ID FL2FAANP0004 KNApSAcK_ID C00008460 NAME Euchrenone a1 CAS_RN 116310-61-3 FORMULA C25H24O5 EXACTMASS 404.162373878 AVERAGEMASS 404.45506 SMILES O(c12)C(c(c5)ccc(c45)OC(C=C4)(C)C)CC(=O)c1c(cc(O3)c2C=CC3(C)C)O M END